| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 31st, 2009 | 22 | Yes |
Popular Name: 3-ethyl-1-(6-hydroxy-6-methyl-heptyl)-7H-purine-2,6-dione 3-ethyl-1-(6-hydroxy-6-methyl-he…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 2.10 | 6.27 | -12.85 | 2 | 7 | 0 | 93 | 308.382 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.61 | 4.94 | -39.23 | 1 | 7 | -1 | 96 | 307.374 | 7 | ↓ |
